%chk=000221289.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221289

0 1
O 1.582847 0.413826 0.382139
O -2.701613 -0.529426 1.545965
C -2.031616 1.287796 0.082036
C -1.704371 -1.178091 -0.615135
C -2.574516 -0.161611 0.164201
C 0.306254 0.326593 -0.298875
C -0.543925 1.354437 0.459498
C -0.237308 -1.103638 -0.164018
C -2.300402 1.887978 -1.299446
C -2.261702 -2.591926 -0.441907
C 2.713530 -0.098106 -0.364733
C 3.914009 0.267319 0.511097
C 5.218689 -0.220492 -0.106203
H -2.598869 1.886625 0.842588
H -1.756037 -0.903460 -1.698653
H -3.634550 -0.207572 -0.176349
H 0.436217 0.610750 -1.364090
H -0.141628 2.369575 0.277914
H -0.418267 1.191735 1.549594
H -0.131447 -1.440206 0.885825
H 0.379284 -1.805175 -0.753929
H -1.966596 2.931336 -1.347737
H -1.777724 1.344636 -2.094014
H -3.369580 1.880004 -1.540080
H -1.605037 -3.346642 -0.884923
H -2.388848 -2.838645 0.621815
H -3.247575 -2.693951 -0.908915
H -1.819266 -0.608102 1.963716
H 2.749947 0.387765 -1.353991
H 2.597337 -1.187830 -0.486023
H 3.937170 1.365351 0.663337
H 3.772881 -0.162933 1.523519
H 5.394181 0.223969 -1.092731
H 6.074452 0.045265 0.526451
H 5.230380 -1.310056 -0.226341


%chk=000221289-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221289

0 1
O 1.613998 0.513938 0.511325
O -2.851665 -0.601545 1.534937
C -2.101603 1.283916 0.081509
C -1.695980 -1.170210 -0.619611
C -2.627731 -0.178391 0.132621
C 0.299451 0.368091 -0.141902
C -0.633275 1.350353 0.588063
C -0.244223 -1.076921 -0.073785
C -2.273092 1.916201 -1.321616
C -2.236749 -2.614116 -0.563269
C 2.721698 -0.141705 -0.197300
C 4.031521 0.367699 0.416062
C 5.270916 -0.292288 -0.227045
H -2.730099 1.863344 0.787230
H -1.680039 -0.849621 -1.683541
H -3.642824 -0.225623 -0.302442
H 0.402620 0.662732 -1.212994
H -0.237629 2.376825 0.479470
H -0.582437 1.117412 1.672362
H -0.204890 -1.422411 0.980919
H 0.402792 -1.764058 -0.651791
H -1.975119 2.980567 -1.303040
H -1.659969 1.414664 -2.092104
H -3.328543 1.868100 -1.648835
H -1.560555 -3.313158 -1.089932
H -2.340411 -2.946213 0.484867
H -3.235054 -2.684285 -1.034206
H -1.996553 -0.519199 2.029442
H 2.675047 0.104723 -1.283462
H 2.653801 -1.247086 -0.094355
H 4.074124 1.466646 0.297636
H 4.010872 0.165586 1.503661
H 5.317214 -0.089038 -1.313762
H 6.202013 0.092297 0.226085
H 5.258673 -1.390127 -0.089595


